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CAS Number: 5591-70-8
4-phenyl-1H-pyrazol-3-amine

Structure

4-phenyl-1H-pyrazol-3-amine
Name: 4-phenyl-1H-pyrazol-3-amine
Synonyms:
General Information
Product Number: 5591708

CAS Registry Number 5591-70-8
Name:
1H-?Pyrazol-?3-?amine, 4-?phenyl-
Pyrazole, 3(or 5)-amino-4-phenyl- (6CI,7CI)
4-Phenyl-1H-pyrazol-3-amine
(4-Phenyl-1H-pyrazol-3-yl)amine
(4-Phenylpyrazol-3-yl)amine
3-Amino-4-phenylpyrazole

 

Chemical Formula: C9H9N3
Exact Mass: 159.08
Molecular Weight: 159.19
m/z: 159.08 (100.0%), 160.08 (10.8%)

 

InChI:InChI=1S/C9H9N3/c10-9-8(6-11-12-9)7-4-2-1-3-5-7/h1-6H,(H3,10,11,12)

InChI Key:QEHKQNYBBLCFIJ-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C(C=C1)C2=C(NN=C2)N

 

Thermal Properties Value Condition Note
Melting Point 178-179 °C Solv: water (7732-18-5); ethanol (64-17-5) (7)CAS
Melting Point 176-177 °C Solv: ethanol (64-17-5) (5)CAS
Melting Point 176 °C Solv: ethanol (64-17-5) (8)IC
Melting Point 175-176 °C Solv: ethanol (64-17-5) (4)CAS
Melting Point See full text   (9)CAS

Specification

98%

References
  1. (4) Salaheldin, Abdellatif M.; Journal of Heterocyclic Chemistry 2008, V45(2), P307-310 CAPLUS
  2. (5) Anwar, Hany Fakhry; ARKIVOC (Gainesville, FL, United States) 2006, (15), P133-141 CAPLUS
  3. (7) Alberti, Carlo; Gazzetta Chimica Italiana 1959, V89, P1017-32 CAPLUS
  4. (8) Ege, Guenter; Journal of Heterocyclic Chemistry 1982, V19(6), P1267-73 CAPLUS
  5. (9) Cook, Leonard; US 3017326 1962 CAPLUS
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